3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-6-methyl-3H-indene-1,2-dione

Systemtic Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-6-methyl-3H-indene-1,2-dione Openeye Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-6-methyl-indane-1,2-dione CAS Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-6-methyl-3H-indene-1,2-dione IUPAC Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-6-methyl-3H-indene-1,2-dione Traditional Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-6-methyl-indane-1,2-quinone Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(C(=O)C2=O)CC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC2=C(C=C1)C(C(=O)C2=O)CC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H19NO3/c1-13-6-7-16-17(10-13)20(24)21(25)18(16)11-19(23)22-9-8-14-4-2-3-5-15(14)12-22/h2-7,10,18H,8-9,11-12H2,1H3